2-[[3-[(4-fluorophenyl)carbonylamino]-4-methyl-phenyl]carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[3-[(4-fluorophenyl)carbonylamino]-4-methyl-phenyl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[3-[(4-fluorobenzoyl)amino]-4-methyl-benzoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[[3-[[(4-fluorophenyl)-oxomethyl]amino]-4-methylphenyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[3-[(4-fluorobenzoyl)amino]-4-methylbenzoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[3-[(4-fluorobenzoyl)amino]-4-methyl-benzoyl]amino]-4-methyl-valeric acid Formula: C21H23FN2O4 MolecularWeight: 386.416723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(CC(C)C)C(=O)O)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(CC(C)C)C(=O)O)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H23FN2O4/c1-12(2)10-18(21(27)28)24-20(26)15-5-4-13(3)17(11-15)23-19(25)14-6-8-16(22)9-7-14/h4-9,11-12,18H,10H2,1-3H3,(H,23,25)(H,24,26)(H,27,28)